SCHEMBL31385126

CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.63

▸	BACE1	P56817	6/20	0.58

▸	BACE2	Q9Y5Z0	3/20	0.58

▸	GLP1R	P43220	4/20	0.54

▸	BCL2L1	Q07817	1/20	0.54

▸	OPRM1	P35372	1/20	0.52

▸	OPRD1	P41143	1/20	0.52

▸	OPRK1	P41145	1/20	0.52

▸	OPRL1	P41146	1/20	0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
Ascaphin-8 SCHEMBL29875628	0.90	TFPI (0.58)	TFPIBACE1BACE2GLP1RBCL2L1
SCHEMBL30431667	0.89	TFPI (0.59)	TFPIBACE1BACE2OPRL1
SCHEMBL29716608	0.88	GLP1R (0.58)	TFPIGLP1R
SCHEMBL29458126	0.88	GLP1R (0.58)	TFPIGLP1R
SCHEMBL30950136	0.86	GLP1R (0.65)	TFPIGLP1R
Pexiganan SCHEMBL17513878	0.85	PSEN1 (0.58)	TFPIGLP1ROPRD1
SCHEMBL29405313	0.85	PSEN1 (0.58)	TFPIGLP1ROPRD1
Pexiganan SCHEMBL476400	0.85	PSEN1 (0.58)	TFPIGLP1ROPRD1
Pexiganan SCHEMBL15247673	0.85	PSEN1 (0.58)	TFPIGLP1ROPRD1
SCHEMBL29431940	0.85	TFPI (0.75)	TFPI

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-119400538-A	Functional polypeptide modified nano composite magnetic bead, method for detecting beta-secretase by using functional polypeptide modified nano composite magnetic bead and application of functional polypeptide modified nano composite magnetic bead	甘肃省科学院传感技术研究所	2025-02-07	—	—	CN	claimed
CN-119400538-B	Functional polypeptide modified nano composite magnetic bead, method for detecting beta-secretase by using functional polypeptide modified nano composite magnetic bead and application of functional polypeptide modified nano composite magnetic bead	甘肃省科学院传感技术研究所	2025-04-04	—	—	CN	disclosed
CN-119400538-A	Functional polypeptide modified nano composite magnetic bead, method for detecting beta-secretase by using functional polypeptide modified nano composite magnetic bead and application of functional polypeptide modified nano composite magnetic bead	甘肃省科学院传感技术研究所	2025-02-07	—	—	CN	disclosed